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CHEBI:105012 - 4-[[[1-oxo-2-[(2-oxo-3-phenyl-1-benzopyran-7-yl)oxy]ethyl]amino]methyl]-1-cyclohexanecarboxylic acid

ChEBI IDCHEBI:105012
ChEBI Name4-[[[1-oxo-2-[(2-oxo-3-phenyl-1-benzopyran-7-yl)oxy]ethyl]amino]methyl]-1-cyclohexanecarboxylic acid
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FormulaC25H25NO6
Net Charge0
Average Mass435.476
Monoisotopic Mass435.16819
SMILESO=C(COc1ccc2cc(-c3ccccc3)c(=O)oc2c1)NCC1CCC(C(=O)O)CC1
InChIInChI=1S/C25H25NO6/c27-23(26-14-16-6-8-18(9-7-16)24(28)29)15-31-20-11-10-19-12-21(17-4-2-1-3-5-17)25(30)32-22(19)13-20/h1-5,10-13,16,18H,6-9,14-15H2,(H,26,27)(H,28,29)
InChIKeyXYKMEDUGXHOUKH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[[1-oxo-2-[(2-oxo-3-phenyl-1-benzopyran-7-yl)oxy]ethyl]amino]methyl]-1-cyclohexanecarboxylic acid (CHEBI:105012) is a isoflavonoid (CHEBI:50753)
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